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CHEBI:5134 - fluticasone

Default Structure
ChEBI IDCHEBI:5134
ChEBI Namefluticasone
Stars
DefinitionA trifluorinated corticosteroid used in the form of its propionate ester for treatment of allergic rhinitis.
Last Modified6 September 2013
DownloadsMolfile
FormulaC22H27F3O4S
Net Charge0
Average Mass444.515
Monoisotopic Mass444.15822
SMILES[H][C@@]12C[C@@H](C)[C@](O)(C(=O)SCF)[C@@]1(C)C[C@H](O)[C@@]1(F)[C@@]2([H])C[C@H](F)C2=CC(=O)C=C[C@@]21C
InChIInChI=1S/C22H27F3O4S/c1-11-6-13-14-8-16(24)15-7-12(26)4-5-19(15,2)21(14,25)17(27)9-20(13,3)22(11,29)18(28)30-10-23/h4-5,7,11,13-14,16-17,27,29H,6,8-10H2,1-3H3/t11-,13+,14+,16+,17+,19+,20+,21+,22+/m1/s1
InChIKeyMGNNYOODZCAHBA-GQKYHHCASA-N
Wikipedia
Roles Classification
Biological Role:
androgen  A sex hormone that stimulates or controls the development and maintenance of masculine characteristics in vertebrates by binding to androgen receptors.
Applications:
anti-asthmatic agent  Any compound that has anti-asthmatic effects.
anti-allergic agent  A drug used to treat allergic reactions.
hypoglycemic agent  A drug which lowers the blood glucose level.
anti-asthmatic drug  A drug used to treat asthma.
ChEBI Ontology
Outgoing Relation(s)
fluticasone (CHEBI:5134) has parent hydride androstane (CHEBI:35509)
fluticasone (CHEBI:5134) has role androgen (CHEBI:50113)
fluticasone (CHEBI:5134) has role anti-allergic agent (CHEBI:50857)
fluticasone (CHEBI:5134) has role anti-asthmatic agent (CHEBI:65023)
fluticasone (CHEBI:5134) has role anti-asthmatic drug (CHEBI:49167)
fluticasone (CHEBI:5134) has role hypoglycemic agent (CHEBI:35526)
fluticasone (CHEBI:5134) is a 11β-hydroxy steroid (CHEBI:35346)
fluticasone (CHEBI:5134) is a 17α-hydroxy steroid (CHEBI:35342)
fluticasone (CHEBI:5134) is a 3-oxo-Δ4 steroid (CHEBI:47909)
fluticasone (CHEBI:5134) is a corticosteroid (CHEBI:50858)
fluticasone (CHEBI:5134) is a fluorinated steroid (CHEBI:50830)
fluticasone (CHEBI:5134) is a thioester (CHEBI:51277)
Incoming Relation(s)
fluticasone furoate (CHEBI:74899) has functional parent fluticasone (CHEBI:5134)
fluticasone propionate (CHEBI:31441) has functional parent fluticasone (CHEBI:5134)
IUPAC Name 
S-(fluoromethyl) (6α,11β,16α,17α)-6,9-difluoro-11,17-dihydroxy-16-methyl-3-oxoandrosta-1,4-diene-17-carbothioate
INNs  Source
fluticasonaChemIDplus
fluticasoneKEGG DRUG
fluticasoneWHO MedNet
fluticasonumChemIDplus
Manual XrefsDatabases
C07815KEGG COMPOUND
D07981KEGG DRUG
FluticasoneWikipedia
Registry NumbersSources
Reaxys:8173308Reaxys
CAS:90566-53-3ChemIDplus
CAS:90566-53-3KEGG COMPOUND
Citations